5-[(2,5-dimethylphenyl)methyl]-6-phenyl-2-prop-2-enylsulfanyl-1,3-diazinan-4-one

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-6-phenyl-2-prop-2-enylsulfanyl-1,3-diazinan-4-one Openeye Name: 2-allylsulfanyl-5-[(2,5-dimethylphenyl)methyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-6-phenyl-2-(prop-2-enylthio)-1,3-diazinan-4-one IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-6-phenyl-2-prop-2-enylsulfanyl-1,3-diazinan-4-one Traditional Name: 2-(allylthio)-5-(2,5-dimethylbenzyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2C(NC(NC2=O)SCC=C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2C(NC(NC2=O)SCC=C)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2OS/c1-4-12-26-22-23-20(17-8-6-5-7-9-17)19(21(25)24-22)14-18-13-15(2)10-11-16(18)3/h4-11,13,19-20,22-23H,1,12,14H2,2-3H3,(H,24,25)